3-methoxycarbonyl-1,2-dimethyl-7-oxidanylidene-4-prop-2-ynyl-pyrrolo[3,2-b]pyridine-6-carboxylic acid

Systemtic Name: 3-methoxycarbonyl-1,2-dimethyl-7-oxidanylidene-4-prop-2-ynyl-pyrrolo[3,2-b]pyridine-6-carboxylic acid Openeye Name: 3-methoxycarbonyl-1,2-dimethyl-7-oxo-4-prop-2-ynyl-pyrrolo[3,2-b]pyridine-6-carboxylic acid CAS Name: 3-methoxycarbonyl-1,2-dimethyl-7-oxo-4-prop-2-ynyl-6-pyrrolo[3,2-b]pyridinecarboxylic acid IUPAC Name: 3-methoxycarbonyl-1,2-dimethyl-7-oxo-4-prop-2-ynylpyrrolo[3,2-b]pyridine-6-carboxylic acid Traditional Name: 3-carbomethoxy-7-keto-1,2-dimethyl-4-propargyl-pyrrolo[3,2-b]pyridine-6-carboxylic acid Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C(=O)C(=CN2CC#C)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1C)C(=O)C(=CN2CC#C)C(=O)O)C(=O)OC

InChI

InChI=1S/C15H14N2O5/c1-5-6-17-7-9(14(19)20)13(18)12-11(17)10(15(21)22-4)8(2)16(12)3/h1,7H,6H2,2-4H3,(H,19,20)